UCSF

ZINC37996811

Substance Information

In ZINC since Heavy atoms Benign functionality
December 21st, 2009 18 No

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.15 4.33 -76.52 2 4 1 75 265.358 4
Hi High (pH 8-9.5) 1.15 3.02 -15.83 1 4 0 70 264.35 4

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )